SCHEMBL1782148

SCHEMBL1782148

CCCCC(OC)C(C)C=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTSK P43235 12/20 0.37
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CTSL P07711 3/20 0.34
CTSB P07858 3/20 0.34
CTSH P09668 2/20 0.34
SLC15A1 P46059 1/20 0.32
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
FDPS P14324 1/20 0.30
DNM1 Q05193 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1785771 0.94 ADH1B (0.41) TSHRSMN1; SMN2CTSKADH1BADH1C
SCHEMBL1784935 0.92 ADH1B (0.44) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL1783091 0.87 TSHR (0.32) TSHRSMN1; SMN2
SCHEMBL1783363 0.83 LMNA (0.36)
SCHEMBL1781446 0.81 GAPDH (0.44) TSHRSMN1; SMN2CTSKADH1BADH1C
SCHEMBL1781445 0.81 GAPDH (0.44) TSHRSMN1; SMN2CTSKADH1BADH1C
SCHEMBL1781380 0.78
SCHEMBL1785064 0.78 PTPN1 (0.35) TSHRSMN1; SMN2CTSKCA1CA2
SCHEMBL1785067 0.78 PTPN1 (0.35) TSHRSMN1; SMN2CTSKCA1CA2
SCHEMBL18671059 0.78

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 TSHR 2479/4885SMN1; SMN2 2144/4885CTSK 4787/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.